6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide

C9H14N4 — CID 83875003

IUPAC6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
SMILES[H]/N=C(\N)c1ncn2c1CCC(C)C2
InChIInChI=1S/C9H14N4/c1-6-2-3-7-8(9(10)11)12-5-13(7)4-6/h5-6H,2-4H2,1H3,(H3,10,11)
InChIKeyHBSJBPZZKIFAEC-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.75
Rot. Bonds1

About 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide

6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide (PubChem CID 83875003) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide.

Molecular Properties

Compound Name6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
PubChem CID83875003
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
SMILES[H]/N=C(\N)c1ncn2c1CCC(C)C2
InChIInChI=1S/C9H14N4/c1-6-2-3-7-8(9(10)11)12-5-13(7)4-6/h5-6H,2-4H2,1H3,(H3,10,11)
InChIKeyHBSJBPZZKIFAEC-UHFFFAOYSA-N
XLogP0.75
TPSA67.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The IUPAC name of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide (CID 83875003) is 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide.
What is the SMILES notation for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The canonical SMILES for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide is [H]/N=C(\N)c1ncn2c1CCC(C)C2.
What is the InChIKey of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
The InChIKey is HBSJBPZZKIFAEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c1-6-2-3-7-8(9(10)11)12-5-13(7)4-6/h5-6H,2-4H2,1H3,(H3,10,11).
What are the key properties of 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide?
6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide has a molecular weight of 178.24 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide is sourced from PubChem (CID 83875003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).